SCHEMBL6315628

SCHEMBL6315628

COc1ccc(OC)c(C(=O)C2CCCCC2c2ccc(F)c(N)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 3/20 0.42
MAPT P10636 3/20 0.42
LMNA P02545 2/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 3/20 0.41
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 2/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
GFER P55789 1/20 0.39
HCRTR1 O43613 1/20 0.37
HCRTR2 O43614 1/20 0.37
KDM2B Q8NHM5 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6322732 0.94 MAPT (0.43) KDM1AMAPTLMNAKDM4EALDH1A1
SCHEMBL6853114 0.92 KDM1A (0.44) KDM1AMAPTLMNAKDM4EALDH1A1
SCHEMBL6314925 0.89 KDM1A (0.42) KDM1AMAPTLMNAKDM4EALDH1A1
SCHEMBL6315787 0.89 MAPT (0.45) KDM1AMAPTLMNAKDM4EALDH1A1
SCHEMBL7117399 0.88 LMNA (0.42) KDM1AMAPTLMNAKDM4EALDH1A1
SCHEMBL6322512 0.87 KDM1A (0.40) KDM1AMAPTLMNAKDM4EALDH1A1
SCHEMBL6322521 0.87 MAPT (0.40) KDM1AMAPTLMNAKDM4EALDH1A1
SCHEMBL6861039 0.87 MAPT (0.40) KDM1AMAPTLMNAKDM4EALDH1A1
SCHEMBL7122963 0.86 MAPT (0.48) KDM1AMAPTLMNAKDM4EALDH1A1
SCHEMBL7125958 0.85 TUBB4A (0.48) KDM1AMAPTLMNAKDM4EALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6887904-B2 Substituted arylcycloalkanes, compositions containing them and use thereof AVENTIS PHARMA S. A. (FR) 2005-05-03 US disclosed
EP-1453783-A1 SUBSTITUTED ARYL-CYCLOALKANES, AND USE THEREOF AS ANTICANCER AGENTS Aventis Pharma S.A. (FR) 2004-09-08 EP disclosed
US-20030149072-A1 Substituted arylcycloalkanes, compositions containing them and use thereof AVENTIS PHARMA S.A. (FR) 2003-08-07 US disclosed
WO-2003048096-A1 SUBSTITUTED ARYL-CYCLOALKANES, AND USE THEREOF AS ANTICANCER AGENTS AVENTIS PHARMA S.A. (FR) 2003-06-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030149072-A1 Substituted arylcycloalkanes, compositions containing them and use thereof ABL1, MCL1, AHR KDM1A 1764/4885MAPT 4538/4885LMNA 3280/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.